For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1(2H)-Isoquinolinone, 3,4,4a,5-tetrahydro-2-(phenylmethyl)-
SpectraBase Compound ID vPs6uilmgq
InChI InChI=1S/C16H17NO/c18-16-15-9-5-4-8-14(15)10-11-17(16)12-13-6-2-1-3-7-13/h1-7,9,14H,8,10-12H2
InChIKey KKXOIFZVCMRSAI-UHFFFAOYSA-N
Mol Weight 239.32 g/mol
Molecular Formula C16H17NO
Exact Mass 239.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 6aDEbWGul3J
Name 1(2H)-Isoquinolinone, 3,4,4a,5-tetrahydro-2-(phenylmethyl)-
Alternate Name(s) 2-Benzyl-3,4,4a,5-tetrahydro-1(2H)-isoquinolinone 2-Benzyl-3,4,4a,5-tetrahydro-1(2H)-isoquinolone
CAS Registry Number 107733-73-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO
InChI InChI=1S/C16H17NO/c18-16-15-9-5-4-8-14(15)10-11-17(16)12-13-6-2-1-3-7-13/h1-7,9,14H,8,10-12H2
InChIKey KKXOIFZVCMRSAI-UHFFFAOYSA-N
Molecular Weight 239.318 g/mol
SMILES C1(N(Cc2ccccc2)CCC2C1=CC=CC2)=O
SPLASH splash10-052u-4970000000-4dc18c2c130d1ec069f4
Source of Spectrum AJ-59-1360-10
Wiley ID 1242166